Ammonia → 2-Chloro-6-[5-(4-chlorophenyl)pyridin-2-ylethynyl]-4-methylquinoline
반응식
[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([C:14]#[C:15][c:16]3[cH:17][c:18]4[c:19]([CH3:27])[cH:20][c:21](=[O:26])[nH:22][c:23]4[cH:24][cH:25]3)[n:12][cH:13]2)[cH:6][cH:7]1.[NH3:33].[P:28]([Cl:29])([Cl:30])([Cl:31])=[O:32]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([C:14]#[C:15][c:16]3[cH:17][c:18]4[c:19]([CH3:27])[cH:20][c:21]([Cl:30])[n:22][c:23]4[cH:24][cH:25]3)[n:12][cH:13]2)[cH:6][cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-0056871cd1914f1889f96b127ca2613a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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